2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol

C7H18N2O2 — CID 21088

IUPAC2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol
SMILESNCCCN(CCO)CCO
InChIInChI=1S/C7H18N2O2/c8-2-1-3-9(4-6-10)5-7-11/h10-11H,1-8H2
InChIKeyFKJVYOFPTRGCSP-UHFFFAOYSA-N
MW162.23 g/mol
LogP-1.38
Rot. Bonds7

About 2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol

2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol (PubChem CID 21088) has the molecular formula C7H18N2O2 and a molecular weight of 162.23 g/mol. Its IUPAC name is 2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol.

Molecular Properties

Compound Name2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol
PubChem CID21088
Molecular FormulaC7H18N2O2
Molecular Weight162.23 g/mol
Exact Mass162.14
IUPAC Name2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol
SMILESNCCCN(CCO)CCO
InChIInChI=1S/C7H18N2O2/c8-2-1-3-9(4-6-10)5-7-11/h10-11H,1-8H2
InChIKeyFKJVYOFPTRGCSP-UHFFFAOYSA-N
XLogP-1.38
TPSA69.72 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 5-1.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-hydroxyethyl)-N-methyl-1,3-propanediamine
CID 11434970
N-(Aminopropyl)ethanolamine
CID 78211
1-Amino-3-(diethylamino)propan-2-ol
CID 97749
N,N-Bis(2-hydroxyethyl)ethylenediamine
CID 98535
2-Propanol, 1,3-bis((2-hydroxyethyl)amino)-
CID 3039236
2-({3-[(2-Hydroxyethyl)amino]propyl}amino)ethan-1-ol
CID 415283
Triethanolammonium
CID 3777650
1-Amino-3-(4-aminobutylamino)propan-2-ol
CID 101196139
2-((3-Aminopropyl)amino)ethan-1-ol dihydrochloride
CID 12519536
2-[(4-Aminobutyl)methylamino]ethanol
CID 12647849
[3-(Dimethylamino)-2-hydroxypropyl](methyl)amine
CID 12700841
1-[(3-Aminopropyl)-(2-hydroxypropyl)-amino]propan-2-OL
CID 22266927

Frequently Asked Questions

What is the IUPAC name of 2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol?
The IUPAC name of 2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol (CID 21088) is 2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol.
What is the SMILES notation for 2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol?
The canonical SMILES for 2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol is NCCCN(CCO)CCO.
What is the InChIKey of 2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol?
The InChIKey is FKJVYOFPTRGCSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2O2/c8-2-1-3-9(4-6-10)5-7-11/h10-11H,1-8H2.
What are the key properties of 2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol?
2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol has a molecular weight of 162.23 g/mol, XLogP of -1.38, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol is sourced from PubChem (CID 21088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).